CID 83479701

Decahydroazulen-2-amine hydrochloride

Structural Information

Molecular Formula
C10H19N
SMILES
C1CCC2CC(CC2CC1)N
InChI
InChI=1S/C10H19N/c11-10-6-8-4-2-1-3-5-9(8)7-10/h8-10H,1-7,11H2
InChIKey
JCGCPPRVIBZTNS-UHFFFAOYSA-N
Compound name
1,2,3,3a,4,5,6,7,8,8a-decahydroazulen-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

153.15175 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.159026 133.0
[M+Na]+ 176.140968 135.6
[M-H]- 152.144474 137.0
[M+NH4]+ 171.185573 154.6
[M+K]+ 192.114908 136.5
[M+H-H2O]+ 136.149010 128.1
[M+HCOO]- 198.149951 151.6
[M+CH3COO]- 212.165601 144.5
[M+Na-2H]- 174.126416 135.7
[M]+ 153.15120142 122.8
[M]- 153.15229858 122.8
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