CID 76224324

(3-methyloxan-4-yl)methanamine

Structural Information

Molecular Formula
C7H15NO
SMILES
CC1COCCC1CN
InChI
InChI=1S/C7H15NO/c1-6-5-9-3-2-7(6)4-8/h6-7H,2-5,8H2,1H3
InChIKey
NJEBROTUBZVEGR-UHFFFAOYSA-N
Compound name
(3-methyloxan-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

129.11537 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.12265 127.6
[M+Na]+ 152.10459 137.9
[M+NH4]+ 147.14919 136.7
[M+K]+ 168.07853 132.5
[M-H]- 128.10809 131.5
[M+Na-2H]- 150.09004 132.3
[M]+ 129.11482 130.0
[M]- 129.11592 130.0
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

No patent data available for this compound.