CID 83678907

2-(oxan-2-yl)propan-2-amine

Structural Information

Molecular Formula
C8H17NO
SMILES
CC(C)(C1CCCCO1)N
InChI
InChI=1S/C8H17NO/c1-8(2,9)7-5-3-4-6-10-7/h7H,3-6,9H2,1-2H3
InChIKey
DHTOWFGYIUTPJG-UHFFFAOYSA-N
Compound name
2-(oxan-2-yl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

143.13101 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.138286 132.5
[M+Na]+ 166.120228 136.8
[M-H]- 142.123734 135.4
[M+NH4]+ 161.164833 152.0
[M+K]+ 182.094168 137.3
[M+H-H2O]+ 126.128270 127.3
[M+HCOO]- 188.129211 151.1
[M+CH3COO]- 202.144861 175.8
[M+Na-2H]- 164.105676 139.1
[M]+ 143.13046142 127.5
[M]- 143.13155858 127.5
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