CID 105430395

2-(3,6-dihydro-2h-pyran-4-yl)-2-methylpropan-1-amine

Structural Information

Molecular Formula
C9H17NO
SMILES
CC(C)(CN)C1=CCOCC1
InChI
InChI=1S/C9H17NO/c1-9(2,7-10)8-3-5-11-6-4-8/h3H,4-7,10H2,1-2H3
InChIKey
BUKWTMMHFLDRGS-UHFFFAOYSA-N
Compound name
2-(3,6-dihydro-2H-pyran-4-yl)-2-methylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.13101 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.138286 135.3
[M+Na]+ 178.120228 140.3
[M-H]- 154.123734 138.5
[M+NH4]+ 173.164833 154.5
[M+K]+ 194.094168 140.3
[M+H-H2O]+ 138.128270 129.9
[M+HCOO]- 200.129211 155.2
[M+CH3COO]- 214.144861 178.4
[M+Na-2H]- 176.105676 142.4
[M]+ 155.13046142 132.2
[M]- 155.13155858 132.2
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.