CID 15495973

(1-methoxycyclopentyl)methanamine

Structural Information

Molecular Formula
C7H15NO
SMILES
COC1(CCCC1)CN
InChI
InChI=1S/C7H15NO/c1-9-7(6-8)4-2-3-5-7/h2-6,8H2,1H3
InChIKey
VVTJJJIVABEZIO-UHFFFAOYSA-N
Compound name
(1-methoxycyclopentyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

129.11537 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.12265 127.8
[M+Na]+ 152.10459 133.9
[M-H]- 128.10809 130.6
[M+NH4]+ 147.14919 152.9
[M+K]+ 168.07853 133.3
[M+H-H2O]+ 112.11263 123.2
[M+HCOO]- 174.11357 151.4
[M+CH3COO]- 188.12922 171.8
[M+Na-2H]- 150.09004 133.2
[M]+ 129.11482 124.7
[M]- 129.11592 124.7
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