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]+ 144.13829 132.5
[M+Na]+ 166.12023 136.8
[M-H]- 142.12373 135.4
[M+NH4]+ 161.16483 152.0
[M+K]+ 182.09417 137.3
[M+H-H2O]+ 126.12827 127.3
[M+HCOO]- 188.12921 151.1
[M+CH3COO]- 202.14486 175.8
[M+Na-2H]- 164.10568 139.1
[M]+ 143.13046 127.5
[M]- 143.13156 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