CID 131142748

(4r)-2-amino-1-methyl-4-(prop-1-en-2-yl)cyclohexan-1-ol

Structural Information

Molecular Formula
C10H19NO
SMILES
CC(=C)[C@@H]1CCC(C(C1)N)(C)O
InChI
InChI=1S/C10H19NO/c1-7(2)8-4-5-10(3,12)9(11)6-8/h8-9,12H,1,4-6,11H2,2-3H3/t8-,9?,10?/m1/s1
InChIKey
YMIYPQKJCIGSLG-XNWIYYODSA-N
Compound name
(4R)-2-amino-1-methyl-4-prop-1-en-2-ylcyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.14667 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.153946 139.7
[M+Na]+ 192.135888 145.2
[M-H]- 168.139394 141.2
[M+NH4]+ 187.180493 161.2
[M+K]+ 208.109828 143.1
[M+H-H2O]+ 152.143930 135.6
[M+HCOO]- 214.144871 157.8
[M+CH3COO]- 228.160521 180.9
[M+Na-2H]- 190.121336 141.7
[M]+ 169.14612142 133.2
[M]- 169.14721858 133.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.