CID 55288723

[(4z)-cyclooct-4-en-1-yl]methanamine hydrochloride

Structural Information

Molecular Formula
C9H17N
SMILES
C1C/C=C\CCC(C1)CN
InChI
InChI=1S/C9H17N/c10-8-9-6-4-2-1-3-5-7-9/h1-2,9H,3-8,10H2/b2-1-
InChIKey
VVDVYPRTAZHSQZ-UPHRSURJSA-N
Compound name
[(4Z)-cyclooct-4-en-1-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

139.1361 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.14338 140.0
[M+Na]+ 162.12532 143.9
[M-H]- 138.12882 141.4
[M+NH4]+ 157.16992 149.6
[M+K]+ 178.09926 144.4
[M+H-H2O]+ 122.13336 136.7
[M+HCOO]- 184.13430 149.9
[M+CH3COO]- 198.14995 219.1
[M+Na-2H]- 160.11077 141.1
[M]+ 139.13555 137.5
[M]- 139.13665 137.5
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