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]+ 170.15395 139.7
[M+Na]+ 192.13589 145.2
[M-H]- 168.13939 141.2
[M+NH4]+ 187.18049 161.2
[M+K]+ 208.10983 143.1
[M+H-H2O]+ 152.14393 135.6
[M+HCOO]- 214.14487 157.8
[M+CH3COO]- 228.16052 180.9
[M+Na-2H]- 190.12134 141.7
[M]+ 169.14612 133.2
[M]- 169.14722 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.