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

3
Patents

139.1361 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.143376 140.0
[M+Na]+ 162.125318 143.9
[M-H]- 138.128824 141.4
[M+NH4]+ 157.169923 149.6
[M+K]+ 178.099258 144.4
[M+H-H2O]+ 122.133360 136.7
[M+HCOO]- 184.134301 149.9
[M+CH3COO]- 198.149951 219.1
[M+Na-2H]- 160.110766 141.1
[M]+ 139.13555142 137.5
[M]- 139.13664858 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