CID 55281968

Rac-(1r,2s,4s)-2-methylbicyclo[2.2.1]heptan-2-amine hydrochloride

Structural Information

Molecular Formula
C8H15N
SMILES
C[C@@]1(C[C@H]2CC[C@@H]1C2)N
InChI
InChI=1S/C8H15N/c1-8(9)5-6-2-3-7(8)4-6/h6-7H,2-5,9H2,1H3/t6-,7+,8-/m0/s1
InChIKey
IYVFVRRYHCTISQ-RNJXMRFFSA-N
Compound name
(1R,2S,4S)-2-methylbicyclo[2.2.1]heptan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

125.12045 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.127726 127.9
[M+Na]+ 148.109668 135.4
[M-H]- 124.113174 130.5
[M+NH4]+ 143.154273 156.9
[M+K]+ 164.083608 133.3
[M+H-H2O]+ 108.117710 124.3
[M+HCOO]- 170.118651 149.9
[M+CH3COO]- 184.134301 173.4
[M+Na-2H]- 146.095116 132.7
[M]+ 125.11990142 124.2
[M]- 125.12099858 124.2
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

patents stripe